SCHEMBL4042234

SCHEMBL4042234

CCCC(NC(=O)Oc1ccc(-c2ccccc2)cc1)C(=O)N1CCC2C1C(=O)CN2S(=O)(=O)c1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELOVL6 Q9H5J4 1/20 0.39
CTSK P43235 19/20 0.38
CTSL P07711 17/20 0.38
CTSS P25774 16/20 0.38
CTSB P07858 2/20 0.37
CTSV O60911 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4042621 0.92 CTSK (0.45) ELOVL6CTSKCTSLCTSSCTSB
SCHEMBL4044230 0.91 CTSL (0.40) ELOVL6CTSKCTSLCTSSCTSB
SCHEMBL4052303 0.89 CTSK (0.35) CTSK
SCHEMBL4046503 0.89 CTSL (0.37) ELOVL6CTSKCTSLCTSSCTSB
SCHEMBL4046656 0.89 CTSK (0.40) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4043139 0.89 ELANE (0.37) CTSK
SCHEMBL4046799 0.89 ALDH1A1 (0.39) ELOVL6CTSKCTSLCTSSCTSB
SCHEMBL4051191 0.88 CTSK (0.37) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4051941 0.88 ELOVL6 (0.38) ELOVL6CTSKCTSLCTSSCTSB
SCHEMBL4041003 0.88 CTSL (0.39) CTSKCTSLCTSSCTSBCTSV

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009103735-A1 COMPOSITION CONTAINING AN AMPHOLYTIC COPOLYMER ON THE BASIS OF QUATERNISED MONOMERS CONTAINING NITROGEN AND AT LEAST ONE POLYMER THAT DIFFERS FROM SAID COPOLYMER, AND USE THEREOF BASF SE (DE) 2009-08-27 WO disclosed